4,8-diethoxy-1,3-dimethyl-2-(4-methylphenyl)cyclohepta[c]pyrrol-2-ium--perchlorate (1/1)
Chemical Structure Depiction of
4,8-diethoxy-1,3-dimethyl-2-(4-methylphenyl)cyclohepta[c]pyrrol-2-ium--perchlorate (1/1)
4,8-diethoxy-1,3-dimethyl-2-(4-methylphenyl)cyclohepta[c]pyrrol-2-ium--perchlorate (1/1)
Compound characteristics
| Compound ID: | 7584-0025 |
| Compound Name: | 4,8-diethoxy-1,3-dimethyl-2-(4-methylphenyl)cyclohepta[c]pyrrol-2-ium--perchlorate (1/1) |
| Molecular Weight: | 435.9 |
| Molecular Formula: | C22 H26 N O2 |
| Salt: | ClO4- |
| Smiles: | CCOc1cccc(c2c1c(C)[n+](c1ccc(C)cc1)c2C)OCC |
| Stereo: | ACHIRAL |
| logP: | 5.5519 |
| logD: | 5.5519 |
| logSw: | -5.8918 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 16.5625 |
| InChI Key: | VKZAMXHGESWSIU-UHFFFAOYSA-N |